UCSF

ZINC41588003

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 29 No

Popular Name: (7Z)-9-methyl-3-(2-pyridylmethyl)-7-(4-pyridylmethylene)-2,4-dihydrofuro[3,2-g][1,3]benzoxazin-6-one (7Z)-9-methyl-3-(2-pyridylmethyl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.16 6.7 -12.42 0 6 0 68 385.423 3 ↓
Mid Mid (pH 6-8) 2.16 7.44 -43.22 1 6 1 70 386.431 3 ↓
Lo Low (pH 4.5-6) 2.16 7.92 -80.96 2 6 2 71 387.439 3 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.